Geometry & MOs

Info

ID:	208818
PubChem CID:	80589732
Reduced:	SN2O2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	268.160935
ΔH_f, kcal/mol:	-76.32
Dipole, Da:	1.11
IP(EA), eV:	-8.98(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-carbamothioyl-N-(cyclohexylmethyl)-N-methylcyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)N(CCO)C(=O)C2(CC2)C(=S)N

DOS

IR

Vibrations